SCHEMBL5043988

SCHEMBL5043988

CN(C)c1ccc(CNc2cc(C(O)/C=C/c3ccc(C(=O)O)c(O)c3)cc3c2C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARA P10276 4/20 0.42
RARB P10826 4/20 0.42
RARG P13631 3/20 0.42
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
RXRA P19793 2/20 0.33
RXRB P28702 2/20 0.33
RXRG P48443 2/20 0.33
MMP8 P22894 1/20 0.32
PTPN1 P18031 1/20 0.32
HDAC1 Q13547 1/20 0.32
ERBB2 P04626 1/20 0.31
KLKB1 P03952 1/20 0.31
MMP13 P45452 1/20 0.31
MMP9 P14780 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5043992 1.00 RARA (0.42) RARARARBRARGMAOAMAOB
SCHEMBL5044002 1.00 RARA (0.42) RARARARBRARGMAOAMAOB
SCHEMBL5047279 0.92 RARA (0.41) RARARARBRARGMAOAMAOB
SCHEMBL5049669 0.91 RARA (0.44) RARARARBRARGRXRAPTPN1
SCHEMBL5049667 0.91 RARA (0.44) RARARARBRARGRXRAPTPN1
SCHEMBL5049673 0.91 RARA (0.44) RARARARBRARGRXRAPTPN1
SCHEMBL5044015 0.91 RARA (0.43) RARARARBRARGRXRARXRB
SCHEMBL5044009 0.91 RARA (0.43) RARARARBRARGRXRARXRB
SCHEMBL5044004 0.91 RARA (0.43) RARARARBRARGRXRARXRB
SCHEMBL5047004 0.89 RARB (0.55) RARARARBRARGRXRARXRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US claimed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 US claimed
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US disclosed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG RARA 1/4885RARB 2/4885RARG 3/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.